SCHEMBL2238017

SCHEMBL2238017

O=C(O)OC(=O)CNc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
LMNA P02545 2/20 0.46
GAA P10253 2/20 0.46
KDM4E B2RXH2 1/20 0.46
KMT2A Q03164 3/20 0.45
MAPT P10636 3/20 0.45
RAB9A P51151 2/20 0.45
MEN1 O00255 2/20 0.45
ERCC1 P07992 3/20 0.44
ERCC4 Q92889 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 1/20 0.44
HPGD P15428 1/20 0.44
AGTR1 P30556 1/20 0.44
DPP7 Q9UHL4 1/20 0.43
PKM P14618 1/20 0.42
AKR1C3 P42330 1/20 0.42
PTPN7 P35236 1/20 0.41
PTPN12 Q05209 1/20 0.41
TP53 P04637 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20594029 0.92 ALDH1A1 (0.47) ALDH1A1LMNAGAAKDM4EKMT2A
SCHEMBL6308809 0.85 PKM (0.47) ALDH1A1LMNAGAAKDM4EKMT2A
SCHEMBL26135537 0.83 ALDH1A1 (0.47) ALDH1A1LMNAGAAKDM4EKMT2A
SCHEMBL1705097 0.83 ALDH1A1 (0.45) ALDH1A1LMNAGAAKDM4EKMT2A
SCHEMBL8697106 0.83 ALDH1A1 (0.42) ALDH1A1LMNAGAAKDM4EKMT2A
SCHEMBL4059093 0.82 ALDH1A1 (0.44) ALDH1A1LMNAGAAKDM4EKMT2A
SCHEMBL8840792 0.82 ALDH1A1 (0.46) ALDH1A1LMNAGAAKDM4EKMT2A
SCHEMBL658053 0.82 LMNA (0.54) ALDH1A1LMNAGAAKDM4EKMT2A
Hydrochloric Acid SCHEMBL76327 0.80 LMNA (0.53) ALDH1A1LMNAGAAKDM4EKMT2A
Benzene SCHEMBL28330086 0.80 LMNA (0.53) ALDH1A1LMNAGAAKDM4EKMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021062491-A1 CIBALACKROT RED DYE COMPOUNDS AND METHODS OF USE IN ORGANIC SOLID-STATE LASERS AND OPTO-ELECTRONIC APPLICATIONS THE UNIVERSITY OF QUEENSLAND (AU) 2021-04-08 WO disclosed
EP-2107093-B1 POLISHING LIQUID COMPOSITION KAO CORP (JP) 2013-02-13 EP disclosed
US-8357311-B2 Polishing liquid composition KAO CORPORATION (JP) 2013-01-22 US disclosed
US-20120232127-A1 REGULATION OF NEUROTRANSMITTER RELEASE THROUGH ANION CHANNELS KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2012-09-13 US disclosed
US-20110201668-A1 REGULATION OF NEUROTRANSMITTER RELEASE THROUGH ANION CHANNELS KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2011-08-18 US disclosed
US-20100056026-A1 POLISHING LIQUID COMPOSITION KAO CORPORATION (JP) 2010-03-04 US disclosed
EP-2107093-A1 POLISHING LIQUID COMPOSITION Kao Corporation (JP) 2009-10-07 EP disclosed
US-5925647-A TREATMENT OF INSULIN NON-INSULIN DEPENDENT DIABETES SHAMAN PHARMACEUTICALS, INC. (US) 1999-07-20 US disclosed
US-5821385-A REACTING 2,4-DICHLOROBENZOIC ACID WITH GLYCINE AND A BASE IN WATER WITH HEAT IN THE PRESENCE OF COPPER AND OXYGEN UNDER BASIC CONDITIONS HOECHST AKTIENGESELLSCHAFT (DE) 1998-10-13 US disclosed
US-5681958-A TREATMENT OF DIABETES SHAMAN PHARMACEUTICALS, INC. (US) 1997-10-28 US disclosed
WO-1996010015-A1 CRYPTOLEPINE ANALOGS WITH HYPOGLYCEMIC ACTIVITY SHAMAN PHARMACEUTICALS, INC. (US) 1996-04-04 WO disclosed
US-4303548-A Process for coating dispersed minute droplets with membrane MITSUBISHI PAPER MILLS, LTD. (JP) 1981-12-01 US disclosed